Information card for entry 4079880

Structure parameters

• Formula: C54 H48 N3 O10.5 P5 Ru
• Calculated formula: C54 H47.5 N3 O10.5 P5 Ru
• Title of publication: Transformations of Alkynes at a Cyclotriphosphato Ruthenium Complex
• Authors of publication: Kanao, Keiichiro; Ikeda, Yousuke; Kimura, Kazuhiro; Kamimura, Sou; Tanabe, Yoshiaki; Mutoh, Yuichiro; Iwasaki, Masakazu; Ishii, Youichi
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 2
• Pages of publication: 527
• a: 45.688 ± 0.008 Å
• b: 10.617 ± 0.002 Å
• c: 26.564 ± 0.005 Å
• α: 90°
• β: 123.517 ± 0.002°
• γ: 90°
• Cell volume: 10743 ± 3 ų
• Cell temperature: 123.1 K
• Ambient diffraction temperature: 123.1 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for all reflections included in the refinement: 0.052
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No